SCHEMBL6819175

SCHEMBL6819175

Cc1nc2c(-c3ccc(OC(F)(F)F)cc3Cl)ncnc2n(CCCC2CC2)c1=O

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 1/20 0.36
FFAR4 Q5NUL3 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6818621 0.95 PIK3CA (0.37) CRHR1
SCHEMBL6822135 0.85 CRHR1 (0.42) CRHR1
SCHEMBL6818672 0.82 CRHR1 (0.40) CRHR1
SCHEMBL6821866 0.82 CRHR1 (0.39) CRHR1
SCHEMBL6814127 0.81 CRHR1 (0.37) CRHR1
SCHEMBL6082552 0.80
SCHEMBL6082613 0.79
SCHEMBL6082618 0.79
SCHEMBL6814390 0.78 PIK3CA (0.42)
SCHEMBL6814575 0.78

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004031189-A1 PYRIDINO AND PYRIMIDINO PYRAZINONES FOR TREATMENT OF ANXIETY AND DEPRESSION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2004-04-15 WO disclosed